Single determinant. More...

Collaboration diagram for csf_module::csforbital:

Public Member Functions
procedure, public	compare_excitations_fast

procedure, public	get_determinants

Private Member Functions
final	destroy_orbitals

Private Attributes
type(csfobject), pointer	csf
	Pointer to the CSFObject with CSF this determinant belongs to. More...

integer	id_dtr
	Offset in the global determinant array. More...

Detailed Description

Single determinant.

Authors: A Al-Refaie, J Benda

Date: 2017 - 2019

Class holding data for a single determinant that forms a part of a configuration state function (CSF). At the moment, it holds just offset in the shared contiguous determinant bit array, which is managed by CSFManager type.

Definition at line 118 of file CSF_module.F90.

Member Function/Subroutine Documentation

◆ compare_excitations_fast()

procedure, public csf_module::csforbital::compare_excitations_fast

Definition at line 122 of file CSF_module.F90.

◆ destroy_orbitals()

final csf_module::csforbital::destroy_orbitals

finalprivate

Definition at line 124 of file CSF_module.F90.

Here is the call graph for this function:

◆ get_determinants()

procedure, public csf_module::csforbital::get_determinants

Definition at line 123 of file CSF_module.F90.

Member Data Documentation

◆ csf

type(csfobject), pointer csf_module::csforbital::csf

private

Pointer to the CSFObject with CSF this determinant belongs to.

Definition at line 119 of file CSF_module.F90.

◆ id_dtr

integer csf_module::csforbital::id_dtr

private

Offset in the global determinant array.

Definition at line 120 of file CSF_module.F90.

The documentation for this type was generated from the following file:

/home/jakub/Dokumenty/codes/ukrmol-in-git/source/mpi-ci-diag/Modules/Hamiltonian/CSF_module.F90

Public Member Functions

Private Member Functions

Private Attributes